SCHEMBL7810302

SCHEMBL7810302

Fc1cccc(F)c1C1=NC(COc2cc(Cl)c(Oc3ncc(C(F)(F)F)cc3Cl)c(Cl)c2)CO1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.44
HPGD P15428 2/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 4/20 0.38
HTT P42858 2/20 0.38
SCN9A Q15858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
XBP1 P17861 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7809988 0.92 RAB9A (0.47) RAB9AHPGDCYP1A2CYP3A4CYP2C19
SCHEMBL7812063 0.90 HPGD (0.43) RAB9AHPGDCYP1A2CYP3A4CYP2C19
SCHEMBL8307927 0.84 RAB9A (0.46) RAB9AHPGDSMN1; SMN2LMNAHTT
SCHEMBL7815772 0.80 FFAR1 (0.41) TAAR1MRGPRX4
SCHEMBL7808387 0.79 FFAR1 (0.42) MRGPRX4
SCHEMBL7815921 0.76 MAPK1 (0.43) LMNASCN9AMAPTNPSR1
SCHEMBL7803670 0.75 TAAR1 (0.37) TAAR1
SCHEMBL7808652 0.74 PTGES (0.36) TAAR1MRGPRX4
SCHEMBL7803617 0.73 TAAR1 (0.46) TAAR1
SCHEMBL8893119 0.72 MRGPRX4 (0.42) MRGPRX4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0553623-B1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL CO (JP) 2001-04-04 EP disclosed
US-5556867-A INSECTICIDES AND MITICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-09-17 US disclosed
EP-0553623-A1 An oxazoline derivative its production and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-04 EP disclosed